| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 24 | Yes |
Popular Name: (2S)-1-isopropoxy-3-[(5-methyl-2-furyl)methyl-(2-morpholinoethyl)amino]propan-2-ol (2S)-1-isopropoxy-3-[(5-methyl-2…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.18 | 1.95 | -7.35 | 1 | 6 | 0 | 58 | 340.464 | 10 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | 4.09 | -39.99 | 2 | 6 | 1 | 60 | 341.472 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 1.18 | 4.22 | -40.93 | 2 | 6 | 1 | 60 | 341.472 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 1.18 | 6.34 | -118.82 | 3 | 6 | 2 | 61 | 342.48 | 10 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
